Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl
TL;DR: Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl (CAS 23904-72-5) is a chemical compound with molecular formula C26H27ClN2O and molecular weight 418.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-1-[4-(4-methylphenyl)piperazin-1-yl]-3-phenylpropan-1-one
Also Known As: beta-(p-Chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl ketone, 1-(3-(p-Chlorophenyl)-3-phenylpropionyl)-4-(p-tolyl)piperazine, 3-(4-chlorophenyl)-1-[4-(4-methylphenyl)piperazin-1-yl]-3-phenylpropan-1-one, KETONE, beta-(p-CHLOROPHENYL)PHENETHYL 4-(p-TOLYL)PIPERAZINYL, Piperazine, 1-(3-(p-chlorophenyl)-3-phenylpropionyl)-4-(p-tolyl)-
| Molecular Formula | C26H27ClN2O |
|---|---|
| Molecular Weight | 418.18 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.18118 |
| Heavy Atoms | 30 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 23904-72-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl |
| InChIKey | RQVFYYPNDANMBP-UHFFFAOYSA-N |
Product Overview
Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl (CAS 23904-72-5), with molecular formula C26H27ClN2O and molecular weight 418.18 g/mol. IUPAC: 3-(4-chlorophenyl)-1-[4-(4-methylphenyl)piperazin-1-yl]-3-phenylpropan-1-one.
Chemical Property Profile of Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl
Property Insights of Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl
The XLogP value of 5.7 indicates that Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl?
The CAS number of Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl is 23904-72-5.
What is the molecular formula of Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl?
The molecular formula of Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl is C26H27ClN2O.
What is the molecular weight of Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl?
The molecular weight of Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl is 418.18 g/mol.
Where can I buy Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl?
You can request a quote for Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl?
Yes, KEHONG BIO provides custom synthesis services for Ketone, beta-(p-chlorophenyl)phenethyl 4-(p-tolyl)piperazinyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.